Výsledky vyhľadávania - "Rajan, Kohulan"

Author Correction: DECIMER.ai: an open platform for automated optical chemical structure identification, segmentation and recognition in scientific publications

Autori: Rajan, Kohulan Brinkhaus, Henning Otto Agea, M. Isabel a ďalší

Zdroj: Nature Communications ; volume 14, issue 1 ; ISSN 2041-1723

Dostupnosť: https://doi.org/10.1038/s41467-023-41814-5
https://www.nature.com/articles/s41467-023-41814-5.pdf
https://www.nature.com/articles/s41467-023-41814-5

Cheminformatics Microservice V3: a web portal for chemical structure manipulation and analysis.

Autori: Rajan, Kohulan Chandrasekhar, Venkata Sharma, Nisha a ďalší

Zdroj: Journal of Cheminformatics; 9/23/2025, Vol. 17 Issue 1, p1-8, 8p

Predmety: CHEMINFORMATICS, WEB-based user interfaces, SYSTEM of systems, OPEN source software, APPLICATION program interfaces, CHEMICAL structure, REPRODUCIBLE research

COCONUT 2.0: a comprehensive overhaul and curation of the collection of open natural products database.

Autori: Chandrasekhar, Venkata Rajan, Kohulan Kanakam, Sri Ram Sagar a ďalší

Zdroj: Nucleic Acids Research; 1/6/2025, Vol. 53 Issue D1, pD634-D643, 10p

DECIMER.ai: an open platform for automated optical chemical structure identification, segmentation and recognition in scientific publications.

Autori: Rajan, Kohulan Brinkhaus, Henning Otto Agea, M. Isabel a ďalší

Zdroj: Nature Communications; 8/19/2023, Vol. 14 Issue 1, p1-18, 18p

Predmety: DEEP learning, CHEMICAL structure, NATURAL language processing, SCIENTIFIC literature, COMPUTER vision, IMAGE recognition (Computer vision)

Cheminformatics Microservice: unifying access to open cheminformatics toolkits.

Autori: Chandrasekhar, Venkata Sharma, Nisha Schaub, Jonas a ďalší

Zdroj: Journal of Cheminformatics; 10/16/2023, Vol. 15 Issue 1, p1-11, 11p

Predmety: CHEMINFORMATICS, SOFTWARE development tools, SOFTWARE as a service, CHEMICAL structure

DECIMER—hand-drawn molecule images dataset.

Autori: Brinkhaus, Henning Otto Zielesny, Achim Steinbeck, Christoph a ďalší

Zdroj: Journal of Cheminformatics; 7/5/2022, Vol. 14 Issue 1, p1-5, 5p

Predmety: CHEMICAL structure, MOLECULES, SYSTEMS development, EVALUATION methodology

STOUT V2.0: SMILES to IUPAC name conversion using transformer models.

Autori: Rajan, Kohulan Zielesny, Achim Steinbeck, Christoph

Zdroj: Journal of Cheminformatics; 12/27/2024, Vol. 16 Issue 1, p1-27, 27p

Predmety: TRANSFORMER models, CHEMICAL nomenclature, DEEP learning, CHEMICAL structure, WEB-based user interfaces

Molecule Set Comparator (MSC): a CDK-based open rich‐client tool for molecule set similarity evaluations.

Autori: Rajan, Kohulan Hein, Jan-Mathis Steinbeck, Christoph a ďalší

Zdroj: Journal of Cheminformatics; 2/1/2021, Vol. 13 Issue 1, p1-5, 5p

Predmety: COMPARATOR circuits, MOLECULES, MACHINE learning

Artificial intelligence for natural product drug discovery

Autori: Mullowney, Michael W. Duncan, Katherine R. Elsayed, Somayah S. a ďalší

Zdroj: ISSN:1474-1776 ; ISSN:1474-1784 ; Nature Reviews Drug Discovery, vol. 22 (11), (895-916.

Predmety: Biotechnology & Applied Microbiology, DATABASE, DESIGN, Life Sciences & Biomedicine, LIGAND-BINDING, MACROMOLECULAR TARGETS, MASS-SPECTROMETRY DATA, MODELS, NONRIBOSOMAL PEPTIDE, Pharmacology & Pharmacy, PREDICTION, Science & Technology, SPECTRA, STRUCTURE ELUCIDATION, Humans, Artificial Intelligence, Algorithms, Machine Learning, Drug Discovery, Drug Design, Biological Products, 06 Biological Sciences, 11 Medical and Health Sciences, 31 Biological sciences, 32 Biomedical and clinical sciences, 42 Health sciences

Popis súboru: application/msword

Relation: https://lirias.kuleuven.be/handle/20.500.12942/743146; https://pubmed.ncbi.nlm.nih.gov/37697042

Dostupnosť: https://lirias.kuleuven.be/handle/20.500.12942/743146
https://hdl.handle.net/20.500.12942/743146
https://lirias.kuleuven.be/retrieve/04c8fbcf-ec64-4af3-861d-c9397c2210a0
https://doi.org/10.1038/s41573-023-00774-7
https://pubmed.ncbi.nlm.nih.gov/37697042

Advancements in hand-drawn chemical structure recognition through an enhanced DECIMER architecture.

Autori: Rajan, Kohulan Brinkhaus, Henning Otto Zielesny, Achim a ďalší

Zdroj: Journal of Cheminformatics; 7/5/2024, Vol. 16 Issue 1, p1-11, 11p

Predmety: DEEP learning, CHEMICAL structure, CONVOLUTIONAL neural networks, IMAGE recognition (Computer vision), TRANSFORMER models, SOURCE code

RanDepict: Random chemical structure depiction generator.

Autori: Brinkhaus, Henning Otto Rajan, Kohulan Zielesny, Achim a ďalší

Zdroj: Journal of Cheminformatics; 6/6/2022, Vol. 14 Issue 1, p1-7, 7p

Predmety: CHEMICAL labeling, DEEP learning, CHEMICAL bond lengths, CHEMICAL structure

SELFIES and the future of molecular string representations

Autori: Krenn, Mario Ai, Qianxiang Barthel, Senja a ďalší

Popis súboru: text

Relation: https://eprints.whiterose.ac.uk/id/eprint/224995/1/1-s2.0-S2666389922002069-main.pdf; Krenn, Mario, Ai, Qianxiang, Barthel, Senja et al. (28 more authors) (2022) SELFIES and the future of molecular string representations. Patterns (New York, N.Y.). 100588. ISSN: 2666-3899

Dostupnosť: https://eprints.whiterose.ac.uk/id/eprint/224995/
https://doi.org/10.1016/j.patter.2022.100588

DECIMER-Segmentation: Automated extraction of chemical structure depictions from scientific literature.

Autori: Rajan, Kohulan Brinkhaus, Henning Otto Sorokina, Maria a ďalší

Zdroj: Journal of Cheminformatics; 3/8/2021, Vol. 13 Issue 1, p1-9, 9p

Predmety: SCIENTIFIC literature, CHEMICAL structure, IMAGE recognition (Computer vision), DEEP learning, WEB-based user interfaces, CHEMICAL models

DECIMER: towards deep learning for chemical image recognition.

Autori: Rajan, Kohulan Zielesny, Achim Steinbeck, Christoph

Zdroj: Journal of Cheminformatics; 10/27/2020, Vol. 12 Issue 1, p1-9, 9p

Predmety: IMAGE recognition (Computer vision), DEEP learning, CHEMICAL structure, FORECASTING

DECIMER 1.0: deep learning for chemical image recognition using transformers.

Autori: Rajan, Kohulan Zielesny, Achim Steinbeck, Christoph

Zdroj: Journal of Cheminformatics; 11/22/2021, Vol. 13 Issue 1, p1-16, 16p

Predmety: IMAGE recognition (Computer vision), DEEP learning, COMPUTATIONAL intelligence, CHEMICAL structure, DATA warehousing, CHEMICAL properties

STOUT: SMILES to IUPAC names using neural machine translation.

Autori: Rajan, Kohulan Zielesny, Achim Steinbeck, Christoph

Zdroj: Journal of Cheminformatics; 4/27/2021, Vol. 13 Issue 1, p1-14, 14p

Predmety: MACHINE translating, STOUT, ARCHAEOLOGICAL human remains, RECURRENT neural networks, HUMAN beings

Korporácia: INTERNATIONAL Union of Pure & Applied Chemistry

COCONUT online: Collection of Open Natural Products database.

Autori: Sorokina, Maria Merseburger, Peter Rajan, Kohulan a ďalší

Zdroj: Journal of Cheminformatics; 1/10/2021, Vol. 13 Issue 1, p1-13, 13p

Predmety: NATURAL products, COCONUT, SMALL molecules, DATABASES, WEB browsing

A review of optical chemical structure recognition tools.

Autori: Rajan, Kohulan Brinkhaus, Henning Otto Zielesny, Achim a ďalší

Zdroj: Journal of Cheminformatics; 10/7/2020, Vol. 12 Issue 1, pN.PAG-N.PAG, 1p

Predmety: MOLECULAR structure, LITERARY form

Bloom filters for molecules.

Autori: Medina, Jorge White, Andrew D.

Zdroj: Journal of Cheminformatics; 10/12/2023, Vol. 15 Issue 1, p1-6, 6p

Predmety: CHEMICAL libraries, MOLECULES, NATURAL products, MEMORY testing, HUMAN fingerprints